| CAS Number | 1779577-11-5 |
| Catalog Number | AG01BALV |
| Chemical Name | tert-butyl octahydro-4H-pyrido[4,3-b][1,4]oxazine-4-carboxylate |
| IUPAC Name | tert-butyl 2,3,4a,5,6,7,8,8a-octahydropyrido[4,3-b][1,4]oxazine-4-carboxylate |
| InChI | InChI=1S/C12H22N2O3/c1-12(2,3)17-11(15)14-6-7-16-10-4-5-13-8-9(10)14/h9-10,13H,4-8H2,1-3H3 |
| InChI Key | OAJIQHJOQXQMMQ-UHFFFAOYSA-N |
| MDL Number | MFCD28390074 |
| Molecular Formula | C12H22N2O3 |
| Molecular Weight | 242.3147 |
| SMILES | O1C2C(N(CC1)C(=O)OC(C)(C)C)CNCC2 |
| Synonyms | 1779577-11-5,
tert-Butyl octahydro-4H-pyrido[4,3-b][1,4]oxazine-4-carboxylate,
AKOS023833197,
tert-butyl octahydro-2H-pyrido[4,3-b]morpholine-4-carboxylate,
|
| Complexity | 288 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 242.163g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 242.319g/mol |
| Monoisotopic Mass | 242.163g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 50.8A^2 |
| Undefined Atom Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.6 |
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Certificate of Analysis
Lot Number